3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine

C15H20N4O2S — CID 95772861

IUPAC3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine
SMILESc1csc([C@H](CNc2nc(C3CC3)no2)N2CCOCC2)c1
InChIInChI=1S/C15H20N4O2S/c1-2-13(22-9-1)12(19-5-7-20-8-6-19)10-16-15-17-14(18-21-15)11-3-4-11/h1-2,9,11-12H,3-8,10H2,(H,16,17,18)/t12-/m0/s1
InChIKeyCUTYUOHWZTVKRL-LBPRGKRZSA-N
MW320.42 g/mol
LogP2.49
Rot. Bonds6

About 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine

3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine (PubChem CID 95772861) has the molecular formula C15H20N4O2S and a molecular weight of 320.42 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine.

Molecular Properties

Compound Name3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine
PubChem CID95772861
Molecular FormulaC15H20N4O2S
Molecular Weight320.42 g/mol
Exact Mass320.13
IUPAC Name3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine
SMILESc1csc([C@H](CNc2nc(C3CC3)no2)N2CCOCC2)c1
InChIInChI=1S/C15H20N4O2S/c1-2-13(22-9-1)12(19-5-7-20-8-6-19)10-16-15-17-14(18-21-15)11-3-4-11/h1-2,9,11-12H,3-8,10H2,(H,16,17,18)/t12-/m0/s1
InChIKeyCUTYUOHWZTVKRL-LBPRGKRZSA-N
XLogP2.49
TPSA63.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.42
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine with MolForge

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Launch Full Analysis

Related Compounds

(3R)-3-[[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]amino]oxolan-2-one
CID 95740548
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)cyclopentanamine
CID 167947795
3,3-dimethyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)butan-1-amine
CID 119160582
5-tert-butyl-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine
CID 127616527
2-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]quinolin-4-amine
CID 97068034
4-N,4-N-dimethyl-2-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyrimidine-2,4-diamine
CID 133382668
6-methyl-N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]imidazo[2,1-b][1,3,4]thiadiazol-2-amine
CID 94003063
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-3-[(2S)-oxolan-2-yl]propanamide
CID 94097446
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 51535949
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(trifluoromethyl)quinolin-4-amine
CID 97083929
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 20899204
5-methyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2-oxazole-3-carboxamide
CID 93482387

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine?
The IUPAC name of 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine (CID 95772861) is 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine.
What is the SMILES notation for 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine?
The canonical SMILES for 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine is c1csc([C@H](CNc2nc(C3CC3)no2)N2CCOCC2)c1.
What is the InChIKey of 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine?
The InChIKey is CUTYUOHWZTVKRL-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H20N4O2S/c1-2-13(22-9-1)12(19-5-7-20-8-6-19)10-16-15-17-14(18-21-15)11-3-4-11/h1-2,9,11-12H,3-8,10H2,(H,16,17,18)/t12-/m0/s1.
What are the key properties of 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine?
3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine has a molecular weight of 320.42 g/mol, XLogP of 2.49, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-1,2,4-oxadiazol-5-amine is sourced from PubChem (CID 95772861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).